Basic information
- Standard SMILES
N#Cc1nc(Cl)c(-c2ccccc2)nc1C#N- InChIKey
DFRQYBQBGUHFHV-UHFFFAOYSA-N- Molecular formula
- C12H5ClN4
- Average molar mass
- 240.65 g/mol
Names & identifiers
- Preferred name
- 5-Chloro-6-phenylpyrazine-2,3-dicarbonitrile
- IUPAC
- 5-chloro-6-phenylpyrazine-2,3-dicarbonitrile
Names & synonyms
5-chloro-6-phenylpyrazine-2,3-dicarbonitrile72111-65-0SCHEMBL11084545DFRQYBQBGUHFHV-UHFFFAOYSA-N2,3-dicyano-5-chloro-6-phenylpyrazineEN300-77572
Database identifiers
- PubChem CID
- 12907205
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 73.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 359
Related reactions
12 records
Compound notes
Loading…